SCHEMBL4084893

SCHEMBL4084893

COc1ccc2cc(-c3n[nH]c4ccc(-c5n[nH]c(CC6CCN(C)CC6)n5)cc34)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.52
GSK3B P49841 5/20 0.47
CSNK1D P48730 1/20 0.46
LRRK2 Q5S007 5/20 0.43
CLK2 P49760 1/20 0.42
CLK3 P49761 1/20 0.42
DYRK1A Q13627 1/20 0.42
AXL P30530 1/20 0.42
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
TTK P33981 1/20 0.40
PIK3CG P48736 1/20 0.38
AOC3 Q16853 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5388496 0.85 ADORA2A (0.58) ADORA2AGSK3BCSNK1DLRRK2DYRK1A
SCHEMBL13812153 0.84 GSK3B (0.47) GSK3BLRRK2CLK2CLK3DYRK1A
SCHEMBL4080023 0.82 CSNK1D (0.56) ADORA2AGSK3BCSNK1DLRRK2CLK2
SCHEMBL5246773 0.82 CSNK1D (0.68) ADORA2AGSK3BCSNK1DLRRK2CLK2
SCHEMBL4085697 0.82 CSNK1D (0.51) ADORA2ACSNK1DLRRK2CLK2
SCHEMBL4090371 0.81 CSNK1D (0.67) ADORA2AGSK3BCSNK1DLRRK2CLK2
SCHEMBL4080101 0.81 CSNK1D (0.52) ADORA2ACSNK1DLRRK2
SCHEMBL4085531 0.81 CLK2 (0.53) ADORA2AGSK3BCSNK1DCLK2CLK3
SCHEMBL4080009 0.81 CSNK1D (0.49) ADORA2ACSNK1DLRRK2TTK
SCHEMBL4080007 0.81 CSNK1D (0.49) ADORA2ACSNK1DLRRK2TTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 ADORA2A 1535/4885GSK3B 8/4885CSNK1D 702/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 ADORA2A 1577/4885GSK3B 8/4885CSNK1D 687/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.